1-[(2S)-1-[(1-ethyl-5-methyl-pyrazol-4-yl)methylamino]-1-oxidanylidene-propan-2-yl]pyrazole-3-carboxylic acid

Systemtic Name: 1-[(2S)-1-[(1-ethyl-5-methyl-pyrazol-4-yl)methylamino]-1-oxidanylidene-propan-2-yl]pyrazole-3-carboxylic acid Openeye Name: 1-[(1S)-2-[(1-ethyl-5-methyl-pyrazol-4-yl)methylamino]-1-methyl-2-oxo-ethyl]pyrazole-3-carboxylic acid CAS Name: 1-[(2S)-1-[(1-ethyl-5-methyl-4-pyrazolyl)methylamino]-1-oxopropan-2-yl]-3-pyrazolecarboxylic acid IUPAC Name: 1-[(2S)-1-[(1-ethyl-5-methylpyrazol-4-yl)methylamino]-1-oxopropan-2-yl]pyrazole-3-carboxylic acid Traditional Name: 1-[(1S)-2-[(1-ethyl-5-methyl-pyrazol-4-yl)methylamino]-2-keto-1-methyl-ethyl]pyrazole-3-carboxylic acid Formula: C14H19N5O3 MolecularWeight: 305.33236

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)CNC(=O)C(C)N2C=CC(=N2)C(=O)O)C

Isomeric SMILES

CCN1C(=C(C=N1)CNC(=O)[C@H](C)N2C=CC(=N2)C(=O)O)C

InChI

InChI=1S/C14H19N5O3/c1-4-18-9(2)11(8-16-18)7-15-13(20)10(3)19-6-5-12(17-19)14(21)22/h5-6,8,10H,4,7H2,1-3H3,(H,15,20)(H,21,22)/t10-/m0/s1